1-[4-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]propan-1-one

Systemtic Name: 1-[4-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]propan-1-one Openeye Name: 1-[4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenyl]propan-1-one CAS Name: 1-[4-[(2R)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]phenyl]-1-propanone IUPAC Name: 1-[4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]phenyl]propan-1-one Traditional Name: 1-[4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenyl]propan-1-one Formula: C17H26NO3+ MolecularWeight: 292.39324

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(C[NH+]2CCCCC2)O

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OC[C@@H](C[NH+]2CCCCC2)O

InChI

InChI=1S/C17H25NO3/c1-2-17(20)14-6-8-16(9-7-14)21-13-15(19)12-18-10-4-3-5-11-18/h6-9,15,19H,2-5,10-13H2,1H3/p+1/t15-/m1/s1